SCHEMBL13205358

SCHEMBL13205358

N#Cc1ccc(CN2CCC(N3CCN(c4ncc(C(=O)NCc5cccc(F)c5)cc4Cl)CC3)CC2)cc1

nearest known ligand 0.86

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
CXCR3 P49682 20/20 0.86

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL13205336 0.93 CXCR3 (0.81) CXCR3
SCHEMBL13205868 0.93 CXCR3 (1.00) CXCR3
SCHEMBL13205308 0.92 CXCR3 (0.78) CXCR3
SCHEMBL13205408 0.92 CXCR3 (0.84) CXCR3
SCHEMBL13205291 0.92 CXCR3 (0.87) CXCR3
SCHEMBL13205422 0.91 CXCR3 (0.86) CXCR3
SCHEMBL13205462 0.91 CXCR3 (0.86) CXCR3
SCHEMBL13224719 0.90 CXCR3 (0.74) CXCR3
SCHEMBL13205413 0.90 CXCR3 (0.74) CXCR3
SCHEMBL13205864 0.90 CXCR3 (0.84) CXCR3

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7776862-B2 Pyridyl and phenyl substituted piperazine-piperidines with CXCR3 antagonist activity SCHERING CORPORATION (US) 2010-08-17 US disclosed
US-7776862-B2 Pyridyl and phenyl substituted piperazine-piperidines with CXCR3 antagonist activity SCHERING CORPORATION (US) 2010-08-17 US disclosed
US-20070021611-A1 Pyridyl and phenyl substituted piperazine-piperidines with CXCR3 antagonist activity SCHERING CORPORATION 2007-01-25 US disclosed
US-20070021611-A1 Pyridyl and phenyl substituted piperazine-piperidines with CXCR3 antagonist activity SCHERING CORPORATION 2007-01-25 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20070021611-A1 Pyridyl and phenyl substituted piperazine-piperidines with CXCR3 antagonist activity CXCR3, CCR1, CCR5 CXCR3 1/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.